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137768-49-1 | Phenol, 3-chloro-4-[(3,4-dichlorophenyl)amino]-
CAS No: 137768-49-1 Catalog No: AG0013T8 MDL No:
Product Description
Catalog Number:
AG0013T8
Chemical Name:
Phenol, 3-chloro-4-[(3,4-dichlorophenyl)amino]-
CAS Number:
137768-49-1
Molecular Formula:
C12H8Cl3NO
Molecular Weight:
288.5570
IUPAC Name:
3-chloro-4-(3,4-dichloroanilino)phenol
InChI:
InChI=1S/C12H8Cl3NO/c13-9-3-1-7(5-10(9)14)16-12-4-2-8(17)6-11(12)15/h1-6,16-17H
InChI Key:
BXDBZDGJDKFMLC-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)Cl)Nc1ccc(c(c1)Cl)Cl
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.967g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
288.552g/mol
Monoisotopic Mass:
286.967g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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